E-LIB Suche - Ergebnisse für: Jordan, Kirk E.

1

Topological "Shape" in Micellar Dynamics:

Peters, Thomas J. ; Jordan, Kirk E. ; Li, Ji...
ACS Omega. 9 (2024) 14 - p. 16084-16088 , 2024

2

A physics-inspired approach to the understanding of molecul..:

Dicks, Luke ; Graff, David E. ; Jordan, Kirk E...
Molecular Systems Design & Engineering. 9 (2024) 5 - p. 449-455 , 2024

Link: https://doi.org/10.1039/..

3

Evaluating the roughness of structure–property relationship..:

Graff, David E. ; Pyzer-Knapp, Edward O. ; Jordan, Kirk E...
Digital Discovery. 2 (2023) 5 - p. 1452-1460 , 2023

Link: https://doi.org/10.1039/..

4

Roughness of Molecular Property Landscapes and Its Impact o..:

Aldeghi, Matteo ; Graff, David E. ; Frey, Nathan...
Journal of Chemical Information and Modeling. 62 (2022) 19 - p. 4660-4671 , 2022

Link: https://doi.org/10.1021/..

5

Self-Focusing Virtual Screening with Active Design Space Pr..:

Graff, David E. ; Aldeghi, Matteo ; Morrone, Joseph A....
Journal of Chemical Information and Modeling. 62 (2022) 16 - p. 3854-3862 , 2022

Link: https://doi.org/10.1021/..

6

Bayesian Optimization for Field-Scale Geological Carbon Sto..:

Lu, Xueying ; Jordan, Kirk E. ; Wheeler, Mary F...
Engineering. 18 (2022) - p. 96-104 , 2022

Link: https://doi.org/10.1016/..

7

Simulation of large molecular systems with electronically-d..:

Castangna, Jony ; Martelli, Fausto ; Jordan, Kirk E..
Computer Physics Communications. 264 (2021) - p. 107959 , 2021

Link: https://doi.org/10.1016/..

8

Efficient Algorithm for the Topological Characterization of..:

Conchuir, Breanndan O. ; Gardner, Kirk ; Jordan, Kirk E....
Journal of Chemical Theory and Computation. 16 (2020) 7 - p. 4588-4598 , 2020

Link: https://doi.org/10.1021/..

9

K-mer clustering algorithm using a MapReduce framework: app..:

Kim, Chang Sik ; Winn, Martyn D. ; Sachdeva, Vipin.
BMC Bioinformatics. 18 (2017) 1 - p. , 2017

Link: https://doi.org/10.1186/..

10

Toward a Standard Protocol for Micelle Simulation:

Johnston, Michael A. ; Swope, William C. ; Jordan, Kirk E....
The Journal of Physical Chemistry B. 120 (2016) 26 - p. 6337-6351 , 2016

Link: https://doi.org/10.1021/..

11

A Computational Model for Overcoming Drug Resistance Using ..:

Barakat, Khaled H. ; Huzil, J. Torin ; Jordan, Kirk E....
Molecular Pharmaceutics. 10 (2013) 12 - p. 4572-4589 , 2013

Link: https://doi.org/10.1021/..

12

Enabling High-Performance Computing as a Service:

AbdelBaky, Moustafa ; Parashar, Manish ; Kim, Hyunjoo...
Computer. 45 (2012) 10 - p. 72-80 , 2012

Link: https://doi.org/10.1109/..

13

Preface:

Gatica, Gabriel N. ; Pamela Cook, L. ; Jordan, Kirk E....
Applied Numerical Mathematics. 62 (2012) 6 - p. 665-666 , 2012

Link: https://doi.org/10.1016/..

14

Modeling the performance of an algebraic multigrid cycle on..:

, In: Proceedings of the international conference on Supercomputing,

Gahvari, Hormozd ; Baker, Allison H. ; Schulz, Martin... - p. 172-181 , 2011

Link: https://dl.acm.org/doi/1..

15

Distributed visualization of 3D thermal convection in the g..:

, In: Parallel Computational Fluid Dynamics 1996,

Jordan, Kirk E. ; Yuen, David A. ; Reuteler, David M.. - p. 243-250 , 1997

Link: https://doi.org/10.1016/..